Vitas-M small molecule compound

1-(4-chlorobenzyl)-4-(methoxycarbonyl)-1H-1,2,3-triazol-5-olate

Catalog ID
STL191467
SMILES COC(=O)c1nnn(c1[O-])Cc1ccc(cc1)Cl

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C11H9ClN3O3 MW 266.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H10ClN3O3/c1-18-11(17)9-10(16)15(14-13-9)6-7-2-4-8(12)5-3-7/h2-5,16H,6H2,1H3/p-1
InChIKey
PKZKSBXNLADTIE-UHFFFAOYSA-M
Synonyms

1(4chlorobenzyl)4(methoxycarbonyl)1H123triazol5olate
COC(=O)c1nnn(c1(O))Cc1ccc(cc1)Cl
MFCD11986468
ZINC000026421214

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.